Cas no 849805-96-5 (2-Pyridinemethanamine, 4-phenoxy-)
849805-96-5 structure
Product Name:2-Pyridinemethanamine, 4-phenoxy-
CAS No:849805-96-5
MF:C12H12N2O
MW:200.236482620239
CID:4225963
PubChem ID:23130450
Update Time:2025-04-24
2-Pyridinemethanamine, 4-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinemethanamine, 4-phenoxy-
- C-(4-Phenoxy-pyridin-2-yl)-methylamine
- 4-Phenoxy-2-pyridinemethanamine
- (4-phenoxypyridin-2-yl)methanamine
- 849805-96-5
- AKOS011579772
- IDIJQVCLFARMKV-UHFFFAOYSA-N
- DTXSID401303312
- C-(4Phenoxy-pyridin-2-yl)-methylamine
- SCHEMBL1680487
-
- Inchi： 1S/C12H12N2O/c13-9-10-8-12(6-7-14-10)15-11-4-2-1-3-5-11/h1-8H,9,13H2
- InChI Key： IDIJQVCLFARMKV-UHFFFAOYSA-N
- SMILES： C1(CN)=NC=CC(OC2=CC=CC=C2)=C1
Computed Properties
- Exact Mass: 200.094963011Da
- Monoisotopic Mass: 200.094963011Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 180
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 48.1?2
2-Pyridinemethanamine, 4-phenoxy- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
849805-96-5 (2-Pyridinemethanamine, 4-phenoxy-) Related Products
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